Cas no 25958-59-2 (1H-Indole-2-carboxylic acid, 5-chloro-3-(2-fluorophenyl)-1-methyl-)
25958-59-2 structure
Product Name:1H-Indole-2-carboxylic acid, 5-chloro-3-(2-fluorophenyl)-1-methyl-
CAS No:25958-59-2
MF:C16H11ClFNO2
MW:303.715446710587
CID:1424951
Update Time:2024-08-15
1H-Indole-2-carboxylic acid, 5-chloro-3-(2-fluorophenyl)-1-methyl- Chemical and Physical Properties
Names and Identifiers
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- 1H-Indole-2-carboxylic acid, 5-chloro-3-(2-fluorophenyl)-1-methyl-
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- Inchi： 1S/C16H11ClFNO2/c1-19-13-7-6-9(17)8-11(13)14(15(19)16(20)21)10-4-2-3-5-12(10)18/h2-8H,1H3,(H,20,21)
- InChI Key： YGQTXOMXJSILMT-UHFFFAOYSA-N
- SMILES： N1(C)C2=C(C=C(Cl)C=C2)C(C2=CC=CC=C2F)=C1C(O)=O
Computed Properties
- Exact Mass: 303.04633
Experimental Properties
- Density: 1.37±0.1 g/cm3(Predicted)
- Boiling Point: 477.6±45.0 °C(Predicted)
- PSA: 42.23
- pka: 3.63±0.30(Predicted)
1H-Indole-2-carboxylic acid, 5-chloro-3-(2-fluorophenyl)-1-methyl- Related Literature
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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5. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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